HIT ID: HIT211998263
Cas No: 4291-63-8
分子式: C10H12ClN5O3
分子量: 285.69
常用名: Cladribine
氢键受体数 (HBA): 7
氢键供体数 (HBD): 3
LogP: -0.2817754633333334
IUPAC: (2R,3S,5R)-5-(6-amino-2-chloro-9H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-ol
IUPAC: (2R,3S,5R)-5-(6-amino-2-chloro-9H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-ol
SMILES: Nc1nc(Cl)nc2n(cnc12)[C@H]1C[C@H](O)[C@@H](CO)O1
SMILES: Nc1nc(Cl)nc2n(cnc12)[C@H]1C[C@H](O)[C@@H](CO)O1
InChI key: PTOAARAWEBMLNO-KVQBGUIXSA-N
